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9 search results found

Deepmd Kit ⭐ 1,303

A deep learning package for many-body potential energy representation and molecular dynamics

Dscribe ⭐ 343

DScribe is a python package for creating machine learning descriptors for atomistic systems.

Cross platform, open source application for the processing, visualization, and analysis of 3D tomography data

Dream3d ⭐ 141

Data Analysis program and framework for materials science data analytics, based on the managing framework SIMPL framework.

A high-performance framework for solving phonon and electron Boltzmann equations

The Mesoscale Microstructure Simulation Project

Sqsgenerator ⭐ 28

A command line tool written in Python/C++ for finding optimized SQS structures

Two-dimensional materials manufacturing system

The repository for the Physics-Regulated Interpretable Machine Learning Microstructure Evolution (PRIMME) framework for learning and emulating microstructure grain growth.

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